CHEMBL108187

GPTKB entity

Statements (23)
Predicate Object
gptkbp:instanceOf gptkb:chemical_compound
gptkbp:ATCCode none
gptkbp:CASNumber 153254-86-5
gptkbp:drugClass norepinephrine reuptake inhibitor
gptkbp:hasBiologicalActivity inhibits norepinephrine reuptake
gptkbp:hasInChIKey QKJXYYOQSYFJNP-UHFFFAOYSA-N
gptkbp:hasMolecularFormula C17H19NO3
gptkbp:hasSMILES COC1=CC=CC=C1OCC(CN(C)C)C2=CC=CC=C2
gptkbp:hasStandardInChI InChI=1S/C17H19NO3/c1-18(2)13-12-17(14-8-4-3-5-9-14)21-16-11-7-6-10-15(16)20-19/h3-11,17H,12-13H2,1-2H3
gptkbp:hasUNII 6T6UO8361S
https://www.w3.org/2000/01/rdf-schema#label CHEMBL108187
gptkbp:IUPACName gptkb:(RS)-3-(2-methoxyphenoxy)-N-methyl-3-phenylpropan-1-amine
gptkbp:molecularWeight 285.34
gptkbp:PubChem_CID gptkb:CHEMBL108187
4418
gptkbp:routeOfAdministration oral
gptkbp:status investigational
gptkbp:synonym gptkb:Nisoxetine
gptkb:LY94939
N-methyl-3-phenyl-3-(2-methoxyphenoxy)propan-1-amine
gptkbp:target gptkb:norepinephrine_transporter
gptkbp:bfsParent gptkb:MDEA
gptkbp:bfsLayer 7